1,1-Dioxo-3-(Phenylmethoxy)-3,3a,4,7a-Tetrahydro-2H-1-Benzothiophen-5-One
[CAS# 135138-42-0]

Identification

• Name: 1,1-Dioxo-3-(Phenylmethoxy)-3,3a,4,7a-Tetrahydro-2H-1-Benzothiophen-5-One
• Synonyms: 1,1-Dioxo-3-(Phenylmethoxy)-3,3A,4,7A-Tetrahydro-2H-Benzothiophen-5-One; 3-(Benzyloxy)-1,1-Diketo-3,3A,4,7A-Tetrahydro-2H-Benzothiophen-5-One; 3-Benzyloxy-2,3,3A,7A-Tetrahydrobenzothiophen-5-(4H)-One-1,1-Dioxide
• Molecular Formula: C₁₅H₁₆O₄S
• Molecular Weight: 292.35
• CAS Registry Number: 135138-42-0
• SMILES: C1=CC=CC=C1COC2C[S](C3C2CC(C=C3)=O)(=O)=O
• InChI: 1S/C15H16O4S/c16-12-6-7-15-13(8-12)14(10-20(15,17)18)19-9-11-4-2-1-3-5-11/h1-7,13-15H,8-10H2
• InChIKey: WPOOONGUNIWHDE-UHFFFAOYSA-N

Properties

• Density: 1.34g/cm³ (Cal.)
• Boiling point: 526.861°C at 760 mmHg (Cal.)
• Flash point: 272.436°C (Cal.)